# generated using pymatgen data_TiNb(Mo2W)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.49733452 _cell_length_b 6.35314470 _cell_length_c 13.44079719 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00006822 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TiNb(Mo2W)2 _chemical_formula_sum 'Ti3 Nb3 Mo12 W6' _cell_volume 384.03337370 _cell_formula_units_Z 3 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ti Ti0 1 0.49999115 0.50000000 0.50158471 1.0 Ti Ti1 1 0.00001230 0.00000000 0.66666197 1.0 Ti Ti2 1 0.50002202 0.50000000 0.83174517 1.0 Nb Nb3 1 0.00001237 0.00000000 0.99851087 1.0 Nb Nb4 1 0.49998591 0.50000000 0.16667513 1.0 Nb Nb5 1 0.99998345 0.00000000 0.33482263 1.0 Mo Mo6 1 0.50000901 0.25075168 0.99887468 1.0 Mo Mo7 1 0.50000901 0.74924932 0.99887468 1.0 Mo Mo8 1 0.99998906 0.24966065 0.16667019 1.0 Mo Mo9 1 0.99998906 0.75033935 0.16667019 1.0 Mo Mo10 1 0.49997725 0.25074884 0.33446112 1.0 Mo Mo11 1 0.49997725 0.74925016 0.33446112 1.0 Mo Mo12 1 0.99998941 0.25086175 0.50125868 1.0 Mo Mo13 1 0.99998941 0.74913925 0.50125868 1.0 Mo Mo14 1 0.50001083 0.24965751 0.66666110 1.0 Mo Mo15 1 0.50001083 0.75034149 0.66666110 1.0 Mo Mo16 1 0.00001903 0.25086229 0.83207101 1.0 Mo Mo17 1 0.00001903 0.74913771 0.83207101 1.0 W W18 1 0.00000514 0.50000000 0.99653780 1.0 W W19 1 0.49999365 0.00000000 0.16666711 1.0 W W20 1 0.99998893 0.50000000 0.33680447 1.0 W W21 1 0.49999408 0.00000000 0.50332966 1.0 W W22 1 0.00000715 0.50000000 0.66666488 1.0 W W23 1 0.50001266 0.00000000 0.83000301 1.0